| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2010 | 15 | Yes |
Popular Name: (1S)-N-[(2-methyl-1H-imidazol-4-yl)methyl]-1-(2H-tetrazol-5-yl)ethanamine (1S)-N-[(2-methyl-1H-imidazol-4-…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -0.81 | 0.63 | -41.91 | 3 | 7 | 0 | 98 | 207.241 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.81 | -0.49 | -46.95 | 2 | 7 | -1 | 93 | 206.233 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.81 | -0.51 | -40.71 | 2 | 7 | -1 | 93 | 206.233 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.81 | -0.04 | -49.75 | 3 | 7 | 0 | 95 | 207.241 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.81 | 1.1 | -83.3 | 4 | 7 | 1 | 99 | 208.249 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
